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33545-97-0 | Di-tert-butyl butane-1,4-diyldicarbamate
CAS No: 33545-97-0 Catalog No: AG003SH2 MDL No:MFCD21364426
Product Description
Catalog Number:
AG003SH2
Chemical Name:
Di-tert-butyl butane-1,4-diyldicarbamate
CAS Number:
33545-97-0
Molecular Formula:
C14H28N2O4
Molecular Weight:
288.3831
MDL Number:
MFCD21364426
IUPAC Name:
tert-butyl N-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]carbamate
InChI:
InChI=1S/C14H28N2O4/c1-13(2,3)19-11(17)15-9-7-8-10-16-12(18)20-14(4,5)6/h7-10H2,1-6H3,(H,15,17)(H,16,18)
InChI Key:
OWOZLAYXMYQYNC-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCCCNC(=O)OC(C)(C)C
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.205g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.388g/mol
Monoisotopic Mass:
288.205g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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